5-(3,5-Dimethylphenylthio)-4-ethyl-1,2-dimethyl-1H-imidazole
TL;DR: 5-(3,5-Dimethylphenylthio)-4-ethyl-1,2-dimethyl-1H-imidazole (CAS 1789-95-3) is a chemical compound with molecular formula C15H20N2S and molecular weight 260.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(3,5-dimethylphenyl)sulfanyl-4-ethyl-1,2-dimethylimidazole
Also Known As: 2,4-difluoro-3-methoxylbenzoic acid, 5-(3,5-Dimethylphenylthio)-4-ethyl-1,2-dimethyl-1H-imidazole, 5-[(3,5-dimethylphenyl)sulfanyl]-4-ethyl-1,2-dimethyl-1h-imidazole, 5-(3,5-dimethylphenyl)sulfanyl-4-ethyl-1,2-dimethylimidazole, 5-((3,5-Dimethylphenyl)thio)-4-ethyl-1,2-dimethyl-1H-imidazole
| Molecular Formula | C15H20N2S |
|---|---|
| Molecular Weight | 260.13 g/mol |
| LogP | 4.4 |
| Topological Polar Surface Area | 43.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 260.1347 |
| Heavy Atoms | 18 |
| Complexity | 261.0 |
Chemical Identifiers
| CAS Number | 1789-95-3 |
|---|---|
| SMILES | CCC1=C(N(C(=N1)C)C)SC2=CC(=CC(=C2)C)C |
| InChIKey | RTWXCHWGUXTCTR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5-(3,5-Dimethylphenylthio)-4-ethyl-1,2-dimethyl-1H-imidazole (CAS 1789-95-3), with molecular formula C15H20N2S and molecular weight 260.13 g/mol. IUPAC: 5-(3,5-dimethylphenyl)sulfanyl-4-ethyl-1,2-dimethylimidazole.
Chemical Property Profile of 5-(3,5-Dimethylphenylthio)-4-ethyl-1,2-dimethyl-1H-imidazole
Property Insights of 5-(3,5-Dimethylphenylthio)-4-ethyl-1,2-dimethyl-1H-imidazole
The XLogP value of 4.4 indicates that 5-(3,5-Dimethylphenylthio)-4-ethyl-1,2-dimethyl-1H-imidazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.1 Ų, 5-(3,5-Dimethylphenylthio)-4-ethyl-1,2-dimethyl-1H-imidazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-(3,5-Dimethylphenylthio)-4-ethyl-1,2-dimethyl-1H-imidazole has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 5-(3,5-Dimethylphenylthio)-4-ethyl-1,2-dimethyl-1H-imidazole?
The CAS number of 5-(3,5-Dimethylphenylthio)-4-ethyl-1,2-dimethyl-1H-imidazole is 1789-95-3.
What is the molecular formula of 5-(3,5-Dimethylphenylthio)-4-ethyl-1,2-dimethyl-1H-imidazole?
The molecular formula of 5-(3,5-Dimethylphenylthio)-4-ethyl-1,2-dimethyl-1H-imidazole is C15H20N2S.
What is the molecular weight of 5-(3,5-Dimethylphenylthio)-4-ethyl-1,2-dimethyl-1H-imidazole?
The molecular weight of 5-(3,5-Dimethylphenylthio)-4-ethyl-1,2-dimethyl-1H-imidazole is 260.13 g/mol.
Where can I buy 5-(3,5-Dimethylphenylthio)-4-ethyl-1,2-dimethyl-1H-imidazole?
You can request a quote for 5-(3,5-Dimethylphenylthio)-4-ethyl-1,2-dimethyl-1H-imidazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(3,5-Dimethylphenylthio)-4-ethyl-1,2-dimethyl-1H-imidazole?
Yes, KEHONG BIO provides custom synthesis services for 5-(3,5-Dimethylphenylthio)-4-ethyl-1,2-dimethyl-1H-imidazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.